[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3-chloranyl-4-oxidanyl-phenyl)methanone

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3-chloranyl-4-oxidanyl-phenyl)methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3-chloro-4-hydroxy-phenyl)methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-(3-chloro-4-hydroxyphenyl)methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(3-chloro-4-hydroxyphenyl)methanone Traditional Name: (3-chloro-4-hydroxy-phenyl)-(4-piperonylpiperazino)methanone Formula: C19H19ClN2O4 MolecularWeight: 374.81816

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC(=C(C=C4)O)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC(=C(C=C4)O)Cl

InChI

InChI=1S/C19H19ClN2O4/c20-15-10-14(2-3-16(15)23)19(24)22-7-5-21(6-8-22)11-13-1-4-17-18(9-13)26-12-25-17/h1-4,9-10,23H,5-8,11-12H2